4-(6-piperidin-1-yl-3-pyridinyl)aniline

C16H19N3 — CID 82119925

IUPAC4-(6-piperidin-1-yl-3-pyridinyl)aniline
SMILESNc1ccc(-c2ccc(N3CCCCC3)nc2)cc1
InChIInChI=1S/C16H19N3/c17-15-7-4-13(5-8-15)14-6-9-16(18-12-14)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11,17H2
InChIKeyBLTUADGCXYGEMM-UHFFFAOYSA-N
MW253.35 g/mol
LogP3.32
Rot. Bonds2

About 4-(6-piperidin-1-yl-3-pyridinyl)aniline

4-(6-piperidin-1-yl-3-pyridinyl)aniline (PubChem CID 82119925) has the molecular formula C16H19N3 and a molecular weight of 253.35 g/mol. Its IUPAC name is 4-(6-piperidin-1-yl-3-pyridinyl)aniline.

Molecular Properties

Compound Name4-(6-piperidin-1-yl-3-pyridinyl)aniline
PubChem CID82119925
Molecular FormulaC16H19N3
Molecular Weight253.35 g/mol
Exact Mass253.16
IUPAC Name4-(6-piperidin-1-yl-3-pyridinyl)aniline
SMILESNc1ccc(-c2ccc(N3CCCCC3)nc2)cc1
InChIInChI=1S/C16H19N3/c17-15-7-4-13(5-8-15)14-6-9-16(18-12-14)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11,17H2
InChIKeyBLTUADGCXYGEMM-UHFFFAOYSA-N
XLogP3.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(6-piperidin-1-ylpyridazin-3-yl)aniline
CID 51711955
4-(4-piperidin-1-ylphenyl)aniline
CID 45277459
2,5-di(piperidin-1-yl)pyridine
CID 56695292
(6-piperidin-1-yl-3-pyridinyl)hydrazine
CID 55281305
4-[5-(4-aminophenyl)-1-[4-(6-morpholin-4-yl-3-pyridinyl)phenyl]pyrrolidin-2-yl]aniline
CID 67236705
5-iodo-2-piperidin-1-ylpyridine
CID 44721358
1-(5-bromo-2-pyridinyl)azocane
CID 55137358
1-methyl-4-[[4-(6-pyrrolidin-1-yl-3-pyridinyl)phenyl]methyl]piperazine
CID 146252821
5-(6-pyrrolidin-1-yl-3-pyridinyl)-2,1,3-benzoxadiazole
CID 154766227
5-(6-piperazin-1-yl-3-pyridinyl)pyrimidin-2-amine
CID 141215033
4-amino-N-(6-pyrrolidin-1-yl-3-pyridinyl)benzamide
CID 43704451
5-bromo-2-piperidin-1-ylpyridine;hydrochloride
CID 53217409

Frequently Asked Questions

What is the IUPAC name of 4-(6-piperidin-1-yl-3-pyridinyl)aniline?
The IUPAC name of 4-(6-piperidin-1-yl-3-pyridinyl)aniline (CID 82119925) is 4-(6-piperidin-1-yl-3-pyridinyl)aniline.
What is the SMILES notation for 4-(6-piperidin-1-yl-3-pyridinyl)aniline?
The canonical SMILES for 4-(6-piperidin-1-yl-3-pyridinyl)aniline is Nc1ccc(-c2ccc(N3CCCCC3)nc2)cc1.
What is the InChIKey of 4-(6-piperidin-1-yl-3-pyridinyl)aniline?
The InChIKey is BLTUADGCXYGEMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3/c17-15-7-4-13(5-8-15)14-6-9-16(18-12-14)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11,17H2.
What are the key properties of 4-(6-piperidin-1-yl-3-pyridinyl)aniline?
4-(6-piperidin-1-yl-3-pyridinyl)aniline has a molecular weight of 253.35 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-piperidin-1-yl-3-pyridinyl)aniline is sourced from PubChem (CID 82119925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).